SCHEMBL1150344

SCHEMBL1150344

CCCCNC(CCN)NCCCC

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DPP7 Q9UHL4 1/20 0.40
RRM1 P23921 1/20 0.39
DNM1 Q05193 8/20 0.36
TSHR P16473 2/20 0.36
ALDH1A1 P00352 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
EPHX1 P07099 1/20 0.36
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
CA12 O43570 1/20 0.36
CA7 P43166 1/20 0.36
CA14 Q9ULX7 1/20 0.36
TDP1 Q9NUW8 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL11775651 0.91 RRM1 (0.49) DPP7RRM1DNM1TSHRALDH1A1
SCHEMBL8166834 0.91 RRM1 (0.49) DPP7RRM1DNM1TSHRALDH1A1
SCHEMBL11774595 0.88 DNM1 (0.40) DPP7RRM1DNM1TSHRALDH1A1
SCHEMBL11776112 0.85 DPP7 (0.34) DPP7RRM1CA1
SCHEMBL6658508 0.84 DNM1 (0.40) DPP7DNM1TSHRALDH1A1MEN1
SCHEMBL1721427 0.82 DNM1 (0.44) DPP7DNM1TSHRALDH1A1MEN1
SCHEMBL12056180 0.81 ALDH1A1 (0.39) DPP7RRM1DNM1TSHRALDH1A1
SCHEMBL1885258 0.81 DNM1 (0.36) DNM1TSHRALDH1A1MEN1KMT2A
SCHEMBL6658739 0.81 ALDH1A1 (0.39) DPP7RRM1DNM1TSHRALDH1A1
SCHEMBL11772104 0.80 DNM1 (0.48) DPP7RRM1DNM1TSHRALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8461120-B2 Macrocyclic compounds pounds and methods of use thereof SYNOVO GMBH (DE) 2013-06-11 US disclosed
US-20110183237-A1 ANION CONDUCTING ELECTROLYTE RESIN AND A METHOD FOR PRODUCING THE SAME TOYOTA JIDOSHA KABUSHIKI KAISHA (JP) 2011-07-28 US disclosed
US-20110028417-A1 Macrocyclic Compounds and Methods of Use Thereof SYNOVO GMBH (DE) 2011-02-03 US disclosed
US-7767797-B1 Macrocyclic compounds and methods of use thereof SYNOVO GMBH (DE) 2010-08-03 US disclosed
US-20050059657-A1 Aminoisoxazole derivatives active as kinase inhibitors PFIZER ITALIA S.R.L. (IT) 2005-03-17 US disclosed
US-6677452-B1 PREPARED BY REACTING AMINE WITH PYRIDINE SUBSTITUTED WITH HALOGEN AT POSITION 6 AND WITH CARBOXY OR SULFONYL GROUP AT ANOTHER POSITION TO FORM AMIDE OR SULFONAMIDE, DISPLACING HALOGEN WITH DESIRED DIAMINE LION BIOSCIENCE AG (DE) 2004-01-13 US disclosed
EP-0187371-B1 SUBSTITUTED ISOQUINOLINESULFONYL COMPOUNDS Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1991-06-19 EP disclosed
US-4678783-A CARDIOVASCULAR DISORDERS, HYPOTENSIVES, ARTERIOSCLEROSIS ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1987-07-07 US disclosed
EP-0187371-A2 Substituted isoquinolinesulfonyl compounds Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1986-07-16 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110028417-A1 Macrocyclic Compounds and Methods of Use Thereof H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, PCSK9, CYP11B2 DPP7 165/4885RRM1 2138/4885DNM1 770/4885
US-20050059657-A1 Aminoisoxazole derivatives active as kinase inhibitors MAP3K9, MAP3K19, MAP4K2 DPP7 571/4885RRM1 3985/4885DNM1 3015/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.